β-Methyl-2-(methylthio)-δ-oxobenzenepentanoic acid

CAS Registry Number®

951892-86-7

CAS Name

β-Methyl-2-(methylthio)-δ-oxobenzenepentanoic acid

Molecular Formula

C13H16O3S

Molecular Mass

252.33

Cite this Page

β-Methyl-2-(methylthio)-δ-oxobenzenepentanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951892-86-7 (retrieved 2024-12-22) (CAS RN: 951892-86-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H16O3S/c1-9(8-13(15)16)7-11(14)10-5-3-4-6-12(10)17-2/h3-6,9H,7-8H2,1-2H3,(H,15,16)

InChIKey

InChIKey=GFBYDXKJNMIROM-UHFFFAOYSA-N

SMILES

C(CC(CC(O)=O)C)(=O)C1=C(SC)C=CC=C1

Canonical SMILES

O=C(O)CC(C)CC(=O)C=1C=CC=CC1SC

Other Names for this Substance

  • Benzenepentanoic acid, β-methyl-2-(methylthio)-δ-oxo-
  • β-Methyl-2-(methylthio)-δ-oxobenzenepentanoic acid

CAS INSIGHTSTM
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